LAMMPS (27 Jun 2024 - Development - patch_27Jun2024-930-g7036930360)
# pouring spheres into container box

units		lj
atom_style      sphere
boundary        f f f
dimension	3
comm_modify     vel yes

region          box block -10 10 -10 10 -10 10 units box
create_box      2 box
Created orthogonal box = (-10 -10 -10) to (10 10 10)
  1 by 1 by 1 MPI processor grid

pair_style	hybrid gran/hooke 4000.0 NULL 100.0 NULL 0.5 1
pair_coeff	* * gran/hooke

region          container block -6 6 -6 6 -6 6 units box
fix		container all wall/gran/region hooke/history 		4000.0 NULL 100.0 NULL 0.5 1 region container

neighbor	0.3 bin
neigh_modify	delay 0 every 1 check yes

fix             2 all nve/sphere
fix		3 all gravity 1.0 vector 0 0 -1

region          slab block -2 2 -2 2 -2 2 units box
fix             ins all pour 100 2 4767548 vol 0.4 10 	        diam one 1.0 region slab ignore

timestep	0.005

compute         1 all temp
compute_modify  1 dynamic/dof yes

compute         2 all temp/sphere
compute_modify  2 dynamic/dof yes

thermo		100
thermo_style	custom step atoms temp c_1 c_2 press
thermo_modify   lost ignore
compute_modify  thermo_temp dynamic/dof yes

#dump		2 all image 100 image.*.jpg type type #		zoom 1.4 adiam 1.0 box no 0.0 axes yes 0.9 0.03
#dump_modify	2 pad 5

run	        5000
Generated 0 of 1 mixed pair_coeff terms from geometric mixing rule
Particle insertion: 48 every 566 steps, 100 by step 1133
Neighbor list info ...
  update: every = 1 steps, delay = 0 steps, check = yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 1.3
  ghost atom cutoff = 1.3
  binsize = 0.65, bins = 31 31 31
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair gran/hooke, perpetual
      attributes: half, newton on, size
      pair build: half/size/bin/atomonly/newton
      stencil: half/bin/3d
      bin: standard
Per MPI rank memory allocation (min/avg/max) = 0.5861 | 0.5861 | 0.5861 Mbytes
   Step        Atoms         Temp           c_1            c_2           Press     
         0           0   0              0              0              0            
WARNING: Fewer insertions than requested (../fix_pour.cpp:688)
       100          30   0.803783       0.803783       0.39507978     0.0029137134 
       200          30   1.1967995      1.1967995      0.5882574      0.0043383984 
       300          30   1.2814686      1.2814686      0.62987441     0.0046453238 
       400          30   0.82331082     0.82331082     0.41173176     0.0029845017 
       500          30   0.7708462      0.7708462      0.38777784     0.0043831147 
WARNING: Fewer insertions than requested (../fix_pour.cpp:688)
       600          64   0.51564897     0.51564897     0.26631577     0.0040059368 
       700          64   0.57239348     0.57239348     0.29566901     0.0045075987 
       800          64   0.61837087     0.61837087     0.32195387     0.0048123564 
       900          64   0.53061888     0.53061888     0.28564763     0.0055906552 
      1000          64   0.496299       0.496299       0.26801572     0.0061169128 
      1100          64   0.46068308     0.46068308     0.24699057     0.0055717699 
WARNING: Fewer insertions than requested (../fix_pour.cpp:688)
      1200          99   0.39206225     0.39206225     0.21356546     0.0066294211 
      1300          99   0.38624966     0.38624966     0.21345854     0.0049051051 
      1400          99   0.35615284     0.35615284     0.19785725     0.0046170772 
      1500          99   0.31486693     0.31486693     0.17429055     0.0064903432 
      1600          99   0.26369001     0.26369001     0.15095266     0.0045226847 
      1700         100   0.1925923      0.1925923      0.11308104     0.007362313  
      1800         100   0.13724978     0.13724978     0.083276845    0.0058136373 
      1900         100   0.077212636    0.077212636    0.053159386    0.0016509598 
      2000         100   0.065294031    0.065294031    0.04372752     0.0020346467 
      2100         100   0.057431398    0.057431398    0.037977068    0.0012681098 
      2200         100   0.059093045    0.059093045    0.037435193    0.00096610799
      2300         100   0.03422338     0.03422338     0.025491304    0.00069886052
      2400         100   0.020558284    0.020558284    0.016163009    0.0017260663 
      2500         100   0.015339709    0.015339709    0.012329236    0.00041308031
      2600         100   0.012891354    0.012891354    0.009766054    0.00030356722
      2700         100   0.0092634449   0.0092634449   0.0073580108   0.00077723051
      2800         100   0.0073925841   0.0073925841   0.0059932218   0.00016466767
      2900         100   0.0081228267   0.0081228267   0.006281761    0.00013828388
      3000         100   0.0041833223   0.0041833223   0.0035147096   0.00013160599
      3100         100   0.0035930775   0.0035930775   0.0030039922   0.00060639771
      3200         100   0.0030824465   0.0030824465   0.0026541293   0.00047391014
      3300         100   0.0035087522   0.0035087522   0.0027664508   0.00014080317
      3400         100   0.0018537868   0.0018537868   0.0017099705   6.3326674e-05
      3500         100   0.0015371228   0.0015371228   0.0014155433   0.00021612522
      3600         100   0.001708556    0.001708556    0.0014369892   8.1034202e-05
      3700         100   0.00095948652  0.00095948652  0.0009788528   3.4694023e-05
      3800         100   0.00091875668  0.00091875668  0.00086805146  3.9373686e-05
      3900         100   0.001557068    0.001557068    0.001159526    2.5178607e-05
      4000         100   0.00062012451  0.00062012451  0.00066806922  5.6680551e-06
      4100         100   0.00060940771  0.00060940771  0.00065614741  1.0137901e-05
      4200         100   0.00059538437  0.00059538437  0.00064501521  7.3679744e-06
      4300         100   0.00052946048  0.00052946048  0.00059353641  5.9225081e-06
      4400         100   0.00051202281  0.00051202281  0.00057524772  3.6198435e-05
      4500         100   0.00049986632  0.00049986632  0.00055754521  2.2275519e-05
      4600         100   0.00048187334  0.00048187334  0.00053988815  2.2015243e-05
      4700         100   0.00045261491  0.00045261491  0.00050298355  8.9681339e-05
      4800         100   0.00034965427  0.00034965427  0.0004278781   1.0983535e-05
      4900         100   0.00033555621  0.00033555621  0.00041435167  2.9266598e-05
      5000         100   0.00031387148  0.00031387148  0.00039605781  2.5628425e-05
Loop time of 0.0497806 on 1 procs for 5000 steps with 100 atoms

Performance: 43390431.056 tau/day, 100440.813 timesteps/s, 10.044 Matom-step/s
99.8% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0.0052991  | 0.0052991  | 0.0052991  |   0.0 | 10.64
Neigh   | 0.008529   | 0.008529   | 0.008529   |   0.0 | 17.13
Comm    | 0.00050137 | 0.00050137 | 0.00050137 |   0.0 |  1.01
Output  | 0.00028923 | 0.00028923 | 0.00028923 |   0.0 |  0.58
Modify  | 0.033612   | 0.033612   | 0.033612   |   0.0 | 67.52
Other   |            | 0.00155    |            |       |  3.11

Nlocal:            100 ave         100 max         100 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:              0 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:            164 ave         164 max         164 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 164
Ave neighs/atom = 1.64
Neighbor list builds = 281
Dangerous builds = 0

region          container delete
variable        theta equal (step-5000)*(4.0*PI/5000)
region          container block -6 6 -6 6 -6 6 units box                 rotate v_theta 0 0 0 0 0 1
run	        5000
Generated 0 of 1 mixed pair_coeff terms from geometric mixing rule
WARNING: Region properties for region container changed between runs, resetting its motion (../fix_wall_gran_region.cpp:96)
Per MPI rank memory allocation (min/avg/max) = 5.837 | 5.837 | 5.837 Mbytes
   Step        Atoms         Temp           c_1            c_2           Press     
      5000         100   0.00031387148  0.00031387148  0.00039605781  2.6174978e-05
      5100         100   0.54537023     0.54537023     0.30042175     0.0087427352 
      5200         100   0.57210852     0.57210852     0.3192468      0.0098134067 
      5300         100   0.7168108      0.7168108      0.38577893     0.011004584  
      5400         100   0.78895524     0.78895524     0.41889428     0.013555713  
      5500         100   0.87797874     0.87797874     0.45689223     0.01565356   
      5600         100   0.95424379     0.95424379     0.48830429     0.014707858  
      5700         100   1.0046012      1.0046012      0.51054927     0.01469179   
      5800         100   1.0371453      1.0371453      0.5262568      0.015576788  
      5900         100   1.0545743      1.0545743      0.5361173      0.01589889   
      6000         100   1.0932949      1.0932949      0.55402214     0.017484573  
      6100         100   1.1148364      1.1148364      0.56241126     0.01721788   
      6200         100   1.1315267      1.1315267      0.57050887     0.017961246  
      6300         100   1.1506124      1.1506124      0.58009471     0.017159062  
      6400         100   1.1663328      1.1663328      0.5876586      0.017935311  
      6500         100   1.1821086      1.1821086      0.59595161     0.018005315  
      6600         100   1.2039397      1.2039397      0.60567524     0.021604662  
      6700         100   1.2269912      1.2269912      0.61770225     0.018907995  
      6800         100   1.2447035      1.2447035      0.6257652      0.020537656  
      6900         100   1.2625323      1.2625323      0.63486698     0.020106131  
      7000         100   1.2617127      1.2617127      0.63318163     0.019670429  
      7100         100   1.260715       1.260715       0.63311254     0.01981063   
      7200         100   1.2790404      1.2790404      0.64079        0.02021891   
      7300         100   1.2760228      1.2760228      0.6395331      0.021749943  
      7400         100   1.2799657      1.2799657      0.64139079     0.020472918  
      7500         100   1.2846472      1.2846472      0.64343078     0.02061003   
      7600         100   1.2883963      1.2883963      0.64491863     0.020748893  
      7700         100   1.2926891      1.2926891      0.6468454      0.02059959   
      7800         100   1.3033563      1.3033563      0.65126208     0.021822102  
      7900         100   1.3025795      1.3025795      0.65069464     0.021213858  
      8000         100   1.3052548      1.3052548      0.65209881     0.021398728  
      8100         100   1.3069801      1.3069801      0.6530457      0.021245966  
      8200         100   1.3092011      1.3092011      0.65438349     0.02122166   
      8300         100   1.3101277      1.3101277      0.65518546     0.021329292  
      8400         100   1.3117013      1.3117013      0.65550345     0.021460379  
      8500         100   1.3144455      1.3144455      0.65685825     0.021604641  
      8600         100   1.3164134      1.3164134      0.65789495     0.021563159  
      8700         100   1.3186879      1.3186879      0.6591421      0.021754259  
      8800         100   1.3216911      1.3216911      0.66041154     0.022161545  
      8900         100   1.3207611      1.3207611      0.65988391     0.021812278  
      9000         100   1.3213163      1.3213163      0.66021107     0.021890934  
      9100         100   1.3224957      1.3224957      0.66088572     0.021825725  
      9200         100   1.3240758      1.3240758      0.66183609     0.021785081  
      9300         100   1.3254189      1.3254189      0.66280087     0.021665121  
      9400         100   1.3325923      1.3325923      0.66627599     0.021935299  
      9500         100   1.3403779      1.3403779      0.66969078     0.022258389  
      9600         100   1.3360821      1.3360821      0.66729084     0.022125375  
      9700         100   1.3364048      1.3364048      0.66733374     0.022084635  
      9800         100   1.3348391      1.3348391      0.66653654     0.021957941  
      9900         100   1.3340902      1.3340902      0.66619851     0.022132442  
     10000         100   1.3341233      1.3341233      0.66625291     0.02242346   
Loop time of 0.170031 on 1 procs for 5000 steps with 100 atoms

Performance: 12703591.746 tau/day, 29406.462 timesteps/s, 2.941 Matom-step/s
99.8% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0.02428    | 0.02428    | 0.02428    |   0.0 | 14.28
Neigh   | 0.02016    | 0.02016    | 0.02016    |   0.0 | 11.86
Comm    | 0.00063308 | 0.00063308 | 0.00063308 |   0.0 |  0.37
Output  | 0.00026926 | 0.00026926 | 0.00026926 |   0.0 |  0.16
Modify  | 0.12295    | 0.12295    | 0.12295    |   0.0 | 72.31
Other   |            | 0.001744   |            |       |  1.03

Nlocal:            100 ave         100 max         100 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:              0 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:            186 ave         186 max         186 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 186
Ave neighs/atom = 1.86
Neighbor list builds = 626
Dangerous builds = 0

region          container delete
region          container block -6 6 -6 6 -6 6 units box
run             5000
Generated 0 of 1 mixed pair_coeff terms from geometric mixing rule
Per MPI rank memory allocation (min/avg/max) = 5.837 | 5.837 | 5.837 Mbytes
   Step        Atoms         Temp           c_1            c_2           Press     
     10000         100   1.3341233      1.3341233      0.66625291     0.022389629  
     10100         100   0.29934208     0.29934208     0.17559716     0.0080511663 
     10200         100   0.15937333     0.15937333     0.10361049     0.0052770441 
     10300         100   0.083457844    0.083457844    0.067443759    0.0019700613 
     10400         100   0.065692832    0.065692832    0.055653291    0.0018339668 
     10500         100   0.052804438    0.052804438    0.045281034    0.0016027455 
     10600         100   0.04328663     0.04328663     0.037333736    0.0010520803 
     10700         100   0.034758594    0.034758594    0.030913039    0.00098209982
     10800         100   0.031059386    0.031059386    0.027743119    0.00043771073
     10900         100   0.025257043    0.025257043    0.023417455    0.00057319686
     11000         100   0.020661736    0.020661736    0.019736355    0.00027957807
     11100         100   0.017347891    0.017347891    0.017523904    0.00033806442
     11200         100   0.013838843    0.013838843    0.013891648    0.0004814668 
     11300         100   0.010848849    0.010848849    0.011429994    0.00017218727
     11400         100   0.0087243303   0.0087243303   0.0089442702   0.00075858277
     11500         100   0.0073404505   0.0073404505   0.0074359014   0.00016419055
     11600         100   0.005593778    0.005593778    0.0059169171   0.00067508582
     11700         100   0.0051164194   0.0051164194   0.0053270943   8.4490639e-05
     11800         100   0.00441161     0.00441161     0.0046984183   8.1750645e-05
     11900         100   0.0040823871   0.0040823871   0.0044273607   0.00057274663
     12000         100   0.0036457853   0.0036457853   0.0041171254   6.4466313e-05
     12100         100   0.0034927566   0.0034927566   0.0039732335   0.00010435211
     12200         100   0.0034030997   0.0034030997   0.0038913895   7.5846038e-05
     12300         100   0.0032970662   0.0032970662   0.0036879396   8.4270392e-05
     12400         100   0.0031107627   0.0031107627   0.0034222463   0.00010403492
     12500         100   0.0029402407   0.0029402407   0.0033029532   3.6385479e-05
     12600         100   0.0027926657   0.0027926657   0.0031897566   4.143403e-05 
     12700         100   0.0026584426   0.0026584426   0.0030863436   0.00017608636
     12800         100   0.0020593472   0.0020593472   0.0024174548   2.5484422e-05
     12900         100   0.0019445876   0.0019445876   0.0023331214   1.3291393e-05
     13000         100   0.0019356798   0.0019356798   0.0023208275   3.7775631e-05
     13100         100   0.001917674    0.001917674    0.0023067328   2.3731216e-05
     13200         100   0.0018402122   0.0018402122   0.0022290175   2.3227838e-05
     13300         100   0.0017947406   0.0017947406   0.0021839926   5.68555e-05  
     13400         100   0.0016930751   0.0016930751   0.0020981569   3.762312e-05 
     13500         100   0.0016591044   0.0016591044   0.0020636607   2.0531417e-05
     13600         100   0.0015170608   0.0015170608   0.0019236349   2.87871e-05  
     13700         100   0.0014040099   0.0014040099   0.0017412115   3.7091497e-05
     13800         100   0.0013892837   0.0013892837   0.0017134626   1.7192386e-05
     13900         100   0.0013189709   0.0013189709   0.0016364794   0.00022920131
     14000         100   0.0012610766   0.0012610766   0.0015926858   1.5605822e-05
     14100         100   0.0010746324   0.0010746324   0.0014018754   1.8598362e-05
     14200         100   0.0010259837   0.0010259837   0.0013546872   1.7918726e-05
     14300         100   0.0008919653   0.0008919653   0.0011534101   0.00015490093
     14400         100   0.00087001531  0.00087001531  0.0011016258   1.0766439e-05
     14500         100   0.00083846397  0.00083846397  0.0010767041   1.0375992e-05
     14600         100   0.0008155908   0.0008155908   0.00105642     1.2582086e-05
     14700         100   0.00080868405  0.00080868405  0.00104978     7.027334e-05 
     14800         100   0.00073613153  0.00073613153  0.00098179118  3.236684e-05 
     14900         100   0.00071371931  0.00071371931  0.00095309072  8.6245124e-06
     15000         100   0.00070031746  0.00070031746  0.0009423403   2.4693888e-05
Loop time of 0.0531531 on 1 procs for 5000 steps with 100 atoms

Performance: 40637346.357 tau/day, 94067.931 timesteps/s, 9.407 Matom-step/s
99.8% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0.0049693  | 0.0049693  | 0.0049693  |   0.0 |  9.35
Neigh   | 0.0033529  | 0.0033529  | 0.0033529  |   0.0 |  6.31
Comm    | 0.00045859 | 0.00045859 | 0.00045859 |   0.0 |  0.86
Output  | 0.00031163 | 0.00031163 | 0.00031163 |   0.0 |  0.59
Modify  | 0.042417   | 0.042417   | 0.042417   |   0.0 | 79.80
Other   |            | 0.001644   |            |       |  3.09

Nlocal:            100 ave         100 max         100 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:              0 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:            157 ave         157 max         157 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 157
Ave neighs/atom = 1.57
Neighbor list builds = 101
Dangerous builds = 0

region          container delete
variable        theta equal (step-15000)*(4.0*PI/5000)
region          container block -6 6 -6 6 -6 6 units box                 rotate v_theta 0 0 0 1 1 1
run	        5000
Generated 0 of 1 mixed pair_coeff terms from geometric mixing rule
Per MPI rank memory allocation (min/avg/max) = 5.837 | 5.837 | 5.837 Mbytes
   Step        Atoms         Temp           c_1            c_2           Press     
     15000         100   0.00070031746  0.00070031746  0.0009423403   2.4820402e-05
     15100         100   1.0378931      1.0378931      0.67940294     0.014665698  
     15200         100   1.0517533      1.0517533      0.69115597     0.01309217   
     15300         100   1.1062671      1.1062671      0.73515555     0.015692859  
     15400         100   1.385963       1.385963       0.89710836     0.022187064  
     15500         100   1.5008849      1.5008849      0.94689573     0.030001316  
     15600         100   1.6919387      1.6919387      1.0471028      0.026806301  
     15700         100   1.8311512      1.8311512      1.1071134      0.024492529  
     15800         100   1.8517819      1.8517819      1.1216762      0.028629961  
     15900         100   1.8895616      1.8895616      1.1177621      0.028934483  
     16000         100   2.0691195      2.0691195      1.1848851      0.032794489  
     16100         100   2.2520282      2.2520282      1.26292        0.030167679  
     16200         100   2.2879859      2.2879859      1.2866695      0.02974115   
     16300         100   2.3679798      2.3679798      1.3150501      0.032771704  
     16400         100   2.3846251      2.3846251      1.3122933      0.029948284  
     16500         100   2.528765       2.528765       1.3886857      0.032511301  
     16600         100   2.5465734      2.5465734      1.4009546      0.033614459  
     16700         100   2.6883939      2.6883939      1.457327       0.039494183  
     16800         100   2.8655546      2.8655546      1.5468292      0.036099395  
     16900         100   2.8919695      2.8919695      1.5768619      0.037384016  
     17000         100   3.0433407      3.0433407      1.6445056      0.037344364  
     17100         100   3.2283804      3.2283804      1.7335616      0.041395151  
     17200         100   3.3098823      3.3098823      1.7794605      0.04616548   
     17300         100   3.3890828      3.3890828      1.8289994      0.050512368  
     17400         100   3.278912       3.278912       1.7770308      0.04270684   
     17500         100   3.3373113      3.3373113      1.7927421      0.056764855  
     17600         100   3.3264731      3.3264731      1.8066541      0.045863538  
     17700         100   3.0707481      3.0707481      1.6881602      0.047285321  
     17800         100   3.0911023      3.0911023      1.7142589      0.040005715  
     17900         100   3.1368         3.1368         1.7314207      0.043475979  
     18000         100   3.1705064      3.1705064      1.7503598      0.042272578  
     18100         100   3.2348301      3.2348301      1.7599183      0.042974559  
     18200         100   3.4676237      3.4676237      1.8675014      0.051937094  
     18300         100   3.460493       3.460493       1.8710624      0.04615202   
     18400         100   3.4132328      3.4132328      1.8379148      0.048316249  
     18500         100   3.6046         3.6046         1.936101       0.046093227  
     18600         100   3.6898847      3.6898847      1.985425       0.048623681  
     18700         100   3.8073645      3.8073645      2.0517694      0.051139644  
     18800         100   3.9453683      3.9453683      2.121645       0.053091211  
     18900         100   3.891796       3.891796       2.1038949      0.047975378  
     19000         100   3.9805517      3.9805517      2.143216       0.052740909  
     19100         100   3.8032187      3.8032187      2.0535533      0.060896481  
     19200         100   3.8956813      3.8956813      2.1023053      0.055995941  
     19300         100   3.8441465      3.8441465      2.0783298      0.055586425  
     19400         100   3.6983054      3.6983054      1.9993476      0.051487825  
     19500         100   3.9082901      3.9082901      2.110386       0.055361137  
     19600         100   3.8183806      3.8183806      2.0521248      0.054637936  
     19700         100   3.9479599      3.9479599      2.123487       0.05654763   
     19800         100   3.7900356      3.7900356      2.0309629      0.055030689  
     19900         100   3.8526352      3.8526352      2.079537       0.052237722  
     20000         100   3.7004965      3.7004965      2.0054313      0.052260073  
Loop time of 0.141466 on 1 procs for 5000 steps with 100 atoms

Performance: 15268708.811 tau/day, 35344.233 timesteps/s, 3.534 Matom-step/s
99.8% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0.0092801  | 0.0092801  | 0.0092801  |   0.0 |  6.56
Neigh   | 0.030749   | 0.030749   | 0.030749   |   0.0 | 21.74
Comm    | 0.00076276 | 0.00076276 | 0.00076276 |   0.0 |  0.54
Output  | 0.00026657 | 0.00026657 | 0.00026657 |   0.0 |  0.19
Modify  | 0.098434   | 0.098434   | 0.098434   |   0.0 | 69.58
Other   |            | 0.001973   |            |       |  1.39

Nlocal:            100 ave         100 max         100 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:              0 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:            144 ave         144 max         144 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 144
Ave neighs/atom = 1.44
Neighbor list builds = 906
Dangerous builds = 0

region          container delete
region          container block -6 6 -6 6 -6 6 units box
run             5000
Generated 0 of 1 mixed pair_coeff terms from geometric mixing rule
Per MPI rank memory allocation (min/avg/max) = 5.837 | 5.837 | 5.837 Mbytes
   Step        Atoms         Temp           c_1            c_2           Press     
     20000         100   3.7004965      3.7004965      2.0054313      0.051978523  
     20100         100   1.0456682      1.0456682      0.65203589     0.01426764   
     20200         100   0.92132571     0.92132571     0.56692143     0.016160496  
     20300         100   0.9080139      0.9080139      0.54653258     0.011333456  
     20400         100   0.95504442     0.95504442     0.56626124     0.011989567  
     20500         100   0.85373295     0.85373295     0.5162143      0.011906206  
     20600         100   1.0224737      1.0224737      0.59801919     0.012676175  
     20700         100   0.98041767     0.98041767     0.57722359     0.015534239  
     20800         100   0.94580127     0.94580127     0.54452681     0.014648617  
     20900         100   0.92685337     0.92685337     0.52998999     0.012221026  
     21000         100   0.67355263     0.67355263     0.38349088     0.0096954349 
     21100         100   0.30344447     0.30344447     0.20123228     0.0065577613 
     21200         100   0.16818819     0.16818819     0.12097279     0.0042401405 
     21300         100   0.10742131     0.10742131     0.082910182    0.0032814832 
     21400         100   0.096764554    0.096764554    0.071534839    0.0029435039 
     21500         100   0.046970465    0.046970465    0.04129138     0.0017468115 
     21600         100   0.032766377    0.032766377    0.026265793    0.0016491276 
     21700         100   0.022152668    0.022152668    0.019394268    0.00050552315
     21800         100   0.020778       0.020778       0.017776111    0.00098557239
     21900         100   0.020778283    0.020778283    0.017641295    0.00074778783
     22000         100   0.01698488     0.01698488     0.01429695     0.0005628648 
     22100         100   0.01418614     0.01418614     0.012102299    0.00051794337
     22200         100   0.013346276    0.013346276    0.011394805    0.00032236098
     22300         100   0.0079928433   0.0079928433   0.0077723623   0.00022112873
     22400         100   0.0076254375   0.0076254375   0.0073027877   0.00031949798
     22500         100   0.0069692597   0.0069692597   0.0069664447   0.00021312177
     22600         100   0.006390305    0.006390305    0.0064208682   0.00041289648
     22700         100   0.0056975941   0.0056975941   0.0057521988   0.00030399038
     22800         100   0.0044357329   0.0044357329   0.0045549598   0.00017846882
     22900         100   0.0036644546   0.0036644546   0.0038064043   0.00023078463
     23000         100   0.002829538    0.002829538    0.0032135364   0.00022739562
     23100         100   0.0027443908   0.0027443908   0.0030949164   0.00020554818
     23200         100   0.0026840272   0.0026840272   0.00304758     0.00016936931
     23300         100   0.0024070816   0.0024070816   0.0027285777   0.00016201789
     23400         100   0.0021175586   0.0021175586   0.0023871632   0.00029731473
     23500         100   0.0020591834   0.0020591834   0.0022740401   0.00015989214
     23600         100   0.0020569788   0.0020569788   0.0022646534   0.00015753267
     23700         100   0.0019823585   0.0019823585   0.0021969033   0.00015346211
     23800         100   0.0021461846   0.0021461846   0.0022696006   0.00025075823
     23900         100   0.001964677    0.001964677    0.0021583248   0.00014863082
     24000         100   0.0019474488   0.0019474488   0.0021316684   0.00013004574
     24100         100   0.0024970295   0.0024970295   0.0023832844   9.8929573e-05
     24200         100   0.0017561148   0.0017561148   0.0019839926   7.1132622e-05
     24300         100   0.0016986298   0.0016986298   0.001930582    7.1465912e-05
     24400         100   0.001571577    0.001571577    0.0018168131   0.00015652173
     24500         100   0.0015605078   0.0015605078   0.001789223    6.9843415e-05
     24600         100   0.0018490208   0.0018490208   0.0019049916   5.2092258e-05
     24700         100   0.0014134222   0.0014134222   0.0016814396   4.4173713e-05
     24800         100   0.0013062268   0.0013062268   0.001520288    3.6497646e-05
     24900         100   0.0012718438   0.0012718438   0.0014563564   3.8597512e-05
     25000         100   0.0012686432   0.0012686432   0.0014211643   4.791856e-05 
Loop time of 0.0562653 on 1 procs for 5000 steps with 100 atoms

Performance: 38389540.983 tau/day, 88864.678 timesteps/s, 8.886 Matom-step/s
99.8% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0.0068337  | 0.0068337  | 0.0068337  |   0.0 | 12.15
Neigh   | 0.0087607  | 0.0087607  | 0.0087607  |   0.0 | 15.57
Comm    | 0.00052045 | 0.00052045 | 0.00052045 |   0.0 |  0.92
Output  | 0.00029698 | 0.00029698 | 0.00029698 |   0.0 |  0.53
Modify  | 0.038112   | 0.038112   | 0.038112   |   0.0 | 67.74
Other   |            | 0.001742   |            |       |  3.10

Nlocal:            100 ave         100 max         100 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:              0 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:            150 ave         150 max         150 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 150
Ave neighs/atom = 1.5
Neighbor list builds = 267
Dangerous builds = 0
Total wall time: 0:00:00
